5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-2410 |
| Compound Name: | 5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 578.71 |
| Molecular Formula: | C32 H26 N4 O3 S2 |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(cc1)Oc1ccccc1)=O)c1cccs1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1189 |
| logD: | 5.2779 |
| logSw: | -5.5192 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.837 |
| InChI Key: | IHNBZPKWMBBBQL-PMERELPUSA-N |